Quantitative Structure-Activity Relationship (QSAR) study of a series of 2-thioarylalkyl benzimidazole derivatives by The Density Functional Theory (DFT)

• Những tác giả chính: Digré Ekozias Béké (Tác giả), Mawa Koné (Tác giả), Fatogoma Diarrasouba (Tác giả)
• Định dạng: Sách
• Được phát hành: Open Journal of Bioinformatics and Biostatistics - Peertechz Publications, 2021-06-28.
• Những chủ đề: Research Article
• Truy cập trực tuyến: Connect to this object online.

<p>In this work, we used the quantum density theory (DFT), B3LYP / 6-311G (d, p) to establish a QSAR (Quantitative Structure Activity Relationships) model on a series of molecules derived from 2-thioarylalkyl-1H -Benzimidazole. This model is built with molecular descriptors and anthelmintic ac...